COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.198  -0.517  -0.634  1.00  0.00           O  
HETATM    2  S   UNL     1      -5.326   0.478  -0.116  1.00  0.00           S  
HETATM    3  O   UNL     1      -5.167   1.758  -0.712  1.00  0.00           O  
HETATM    4  N   UNL     1      -5.799   0.746   1.448  1.00  0.00           N  
HETATM    5  C   UNL     1      -3.721  -0.247  -0.059  1.00  0.00           C  
HETATM    6  S   UNL     1      -2.206   0.646  -0.071  1.00  0.00           S  
HETATM    7  C   UNL     1      -1.287  -0.851   0.006  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.134  -1.897   0.036  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.472  -1.557   0.005  1.00  0.00           C  
HETATM   10  C   UNL     1       0.190  -0.946   0.034  1.00  0.00           C  
HETATM   11  C   UNL     1       1.056   0.107   0.005  1.00  0.00           C  
HETATM   12  N   UNL     1       2.311  -0.419   0.048  1.00  0.00           N  
HETATM   13  N   UNL     1       2.159  -1.812   0.104  1.00  0.00           N  
HETATM   14  N   UNL     1       0.900  -2.083   0.099  1.00  0.00           N  
HETATM   15  C   UNL     1       3.520   0.292   0.039  1.00  0.00           C  
HETATM   16  C   UNL     1       3.509   1.681   0.085  1.00  0.00           C  
HETATM   17  C   UNL     1       4.696   2.388   0.076  1.00  0.00           C  
HETATM   18  C   UNL     1       5.902   1.718   0.020  1.00  0.00           C  
HETATM   19  C   UNL     1       5.924   0.323  -0.027  1.00  0.00           C  
HETATM   20  C   UNL     1       4.725  -0.390  -0.012  1.00  0.00           C  
HETATM   21  C   UNL     1       7.174  -0.374  -0.086  1.00  0.00           C  
HETATM   22  N   UNL     1       8.165  -0.927  -0.132  1.00  0.00           N  
HETATM   23  H   UNL     1      -6.600   0.322   1.792  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.273   1.327   2.021  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.259  -2.296   0.028  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.794  -2.921   0.083  1.00  0.00           H  
HETATM   27  H   UNL     1       0.796   1.154  -0.043  1.00  0.00           H  
HETATM   28  H   UNL     1       2.568   2.210   0.129  1.00  0.00           H  
HETATM   29  H   UNL     1       4.735  -1.469  -0.043  1.00  0.00           H  
HETATM   30  H   UNL     1       4.681   3.467   0.112  1.00  0.00           H  
HETATM   31  H   UNL     1       6.828   2.274   0.012  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    3                                       
CONECT    2    4    5                                                 
CONECT    3    2    2                                                 
CONECT    4    2   23   24                                            
CONECT    5    2    6    9    9                                       
CONECT    6    5    7                                                 
CONECT    7    6    8    8   10                                       
CONECT    8    7    7    9   26                                       
CONECT    9    5    5    8   25                                       
CONECT   10    7   11   11   14                                       
CONECT   11   10   10   12   27                                       
CONECT   12   11   13   15                                            
CONECT   13   12   14   14                                            
CONECT   14   10   13   13                                            
CONECT   15   12   16   20   20                                       
CONECT   16   15   17   17   28                                       
CONECT   17   16   16   18   30                                       
CONECT   18   17   19   19   31                                       
CONECT   19   18   18   20   21                                       
CONECT   20   15   15   19   29                                       
CONECT   21   19   22   22   22                                       
CONECT   22   21   21   21                                            
CONECT   23    4                                                      
CONECT   24    4                                                      
CONECT   25    9                                                      
CONECT   26    8                                                      
CONECT   27   11                                                      
CONECT   28   16                                                      
CONECT   29   20                                                      
CONECT   30   17                                                      
CONECT   31   18                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
